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A programmable optimization environment using the GAMESS-US and MERLIN/MCL packages. Applications on intermolecular interaction energies

Fanis G. Kalatzis, Dimitrios G. Papageorgiou, Ioannis N. Demetropoulos. A programmable optimization environment using the GAMESS-US and MERLIN/MCL packages. Applications on intermolecular interaction energies. Computer Physics Communications, 175(5):359-371, 2006. [doi]

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